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- W2009490780 abstract "The presence of long range coupling between hydrogen atoms is shown for the HF and H 2 O hydrogen bonded systems. The coupling of H atoms critically depends on the spatial orientation of the H atoms being considered. Explicit calculations of the potential curves of the protons are performed using as a model a ring of six HF, or H 2 O, molecules. The method of calculation is the CNDO/2. The strong similarities of the results for H 2 O and HF polymers supports the conclusion that the coupling is essentially due to factors such as the asymmetric equilibrium position of the H atoms, the high electronic polarizability of the system, etc." @default.
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- W2009490780 title "Potential curves for proton motion in H-bonded systems: HF and H2O polymers" @default.
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- W2009490780 doi "https://doi.org/10.1016/0301-0104(74)85029-9" @default.
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